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Benzamide, N-(4-cyanomethylphenyl)-3-methyl-
SpectraBase Compound ID FPAbBRMUtkK
InChI InChI=1S/C16H14N2O/c1-12-3-2-4-14(11-12)16(19)18-15-7-5-13(6-8-15)9-10-17/h2-8,11H,9H2,1H3,(H,18,19)
InChIKey XCQFQJPSHTVDRE-UHFFFAOYSA-N
Mol Weight 250.3 g/mol
Molecular Formula C16H14N2O
Exact Mass 250.110613 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C6TSOMWnv0v
Name Benzamide, N-(4-cyanomethylphenyl)-3-methyl-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H14N2O
InChI InChI=1S/C16H14N2O/c1-12-3-2-4-14(11-12)16(19)18-15-7-5-13(6-8-15)9-10-17/h2-8,11H,9H2,1H3,(H,18,19)
InChIKey XCQFQJPSHTVDRE-UHFFFAOYSA-N
Molecular Weight 250.301 g/mol
SMILES N(C(c1cc(C)ccc1)=O)c1ccc(CC#N)cc1
SPLASH splash10-014i-8920000000-1ced6dc8d987bb12372f
Synonyms N-[4-(cyanomethyl)phenyl]-3-methyl-benzamide
Wiley ID 1442084